In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 16 | Yes |
Popular Name: [3,5-dimethyl-1-(4-pyridylmethyl)pyrazol-4-yl]methanol [3,5-dimethyl-1-(4-pyridylmethyl…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 0.40 | 2.63 | -11.28 | 1 | 4 | 0 | 51 | 217.272 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.40 | 3.09 | -39.09 | 2 | 4 | 1 | 52 | 218.28 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.